6-[(4,6-dimethyl-2-pyridinyl)sulfanyl]-N-ethylpyridin-2-amine

C14H17N3S — CID 102926926

IUPAC6-[(4,6-dimethyl-2-pyridinyl)sulfanyl]-N-ethylpyridin-2-amine
SMILESCCNc1cccc(Sc2cc(C)cc(C)n2)n1
InChIInChI=1S/C14H17N3S/c1-4-15-12-6-5-7-13(17-12)18-14-9-10(2)8-11(3)16-14/h5-9H,4H2,1-3H3,(H,15,17)
InChIKeyWUWCNXHZDYTPTD-UHFFFAOYSA-N
MW259.38 g/mol
LogP3.68
Rot. Bonds4

About 6-[(4,6-dimethyl-2-pyridinyl)sulfanyl]-N-ethylpyridin-2-amine

6-[(4,6-dimethyl-2-pyridinyl)sulfanyl]-N-ethylpyridin-2-amine (PubChem CID 102926926) has the molecular formula C14H17N3S and a molecular weight of 259.38 g/mol. Its IUPAC name is 6-[(4,6-dimethyl-2-pyridinyl)sulfanyl]-N-ethylpyridin-2-amine.

Molecular Properties

Compound Name6-[(4,6-dimethyl-2-pyridinyl)sulfanyl]-N-ethylpyridin-2-amine
PubChem CID102926926
Molecular FormulaC14H17N3S
Molecular Weight259.38 g/mol
Exact Mass259.11
IUPAC Name6-[(4,6-dimethyl-2-pyridinyl)sulfanyl]-N-ethylpyridin-2-amine
SMILESCCNc1cccc(Sc2cc(C)cc(C)n2)n1
InChIInChI=1S/C14H17N3S/c1-4-15-12-6-5-7-13(17-12)18-14-9-10(2)8-11(3)16-14/h5-9H,4H2,1-3H3,(H,15,17)
InChIKeyWUWCNXHZDYTPTD-UHFFFAOYSA-N
XLogP3.68
TPSA37.81 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500259.38
LogP ≤ 53.68
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

6-(2,5-dimethylphenyl)sulfanyl-N-ethylpyridin-2-amine
CID 80893303
N-ethyl-6-pyrimidin-4-ylsulfanylpyridin-2-amine
CID 80888853
N-ethyl-6-(3-fluorophenyl)sulfanylpyridin-2-amine
CID 80890333
N-ethyl-6-(2-methoxyphenyl)sulfanylpyridin-2-amine
CID 80885405
6-(2,5-dimethylphenyl)sulfanyl-N-propylpyridin-2-amine
CID 80893381
N-[[2-[(4,6-dimethyl-2-pyridinyl)sulfanyl]phenyl]methyl]ethanamine
CID 102926107
6-(4-methylphenyl)sulfanyl-N-propylpyridin-2-amine
CID 80885007
4-[(4,6-dimethyl-2-pyridinyl)sulfanyl]-N-propylpyridin-2-amine
CID 102926949
N-[[4-[(4,6-dimethyl-2-pyridinyl)sulfanyl]phenyl]methyl]ethanamine
CID 102926128
3-[[6-(ethylamino)-2-pyridinyl]sulfanyl]-4-methyl-1H-1,2,4-triazol-5-one
CID 80892539
6-[2-(dimethylamino)ethylsulfanyl]-N-ethylpyridin-2-amine
CID 80894664
3-[(4,6-dimethyl-2-pyridinyl)sulfanylmethyl]-N-ethylpyridin-2-amine
CID 102925843

Frequently Asked Questions

What is the IUPAC name of 6-[(4,6-dimethyl-2-pyridinyl)sulfanyl]-N-ethylpyridin-2-amine?
The IUPAC name of 6-[(4,6-dimethyl-2-pyridinyl)sulfanyl]-N-ethylpyridin-2-amine (CID 102926926) is 6-[(4,6-dimethyl-2-pyridinyl)sulfanyl]-N-ethylpyridin-2-amine.
What is the SMILES notation for 6-[(4,6-dimethyl-2-pyridinyl)sulfanyl]-N-ethylpyridin-2-amine?
The canonical SMILES for 6-[(4,6-dimethyl-2-pyridinyl)sulfanyl]-N-ethylpyridin-2-amine is CCNc1cccc(Sc2cc(C)cc(C)n2)n1.
What is the InChIKey of 6-[(4,6-dimethyl-2-pyridinyl)sulfanyl]-N-ethylpyridin-2-amine?
The InChIKey is WUWCNXHZDYTPTD-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H17N3S/c1-4-15-12-6-5-7-13(17-12)18-14-9-10(2)8-11(3)16-14/h5-9H,4H2,1-3H3,(H,15,17).
What are the key properties of 6-[(4,6-dimethyl-2-pyridinyl)sulfanyl]-N-ethylpyridin-2-amine?
6-[(4,6-dimethyl-2-pyridinyl)sulfanyl]-N-ethylpyridin-2-amine has a molecular weight of 259.38 g/mol, XLogP of 3.68, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[(4,6-dimethyl-2-pyridinyl)sulfanyl]-N-ethylpyridin-2-amine is sourced from PubChem (CID 102926926), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).